cis-(1R,2S)-2-(2-trimethylsilylethynyl)cyclopentan-1-ol

C10H18OSi — CID 11116689

IUPACcis-(1R,2S)-2-(2-trimethylsilylethynyl)cyclopentan-1-ol
SMILESC[Si](C)(C)C#C[C@@H]1CCC[C@H]1O
InChIInChI=1S/C10H18OSi/c1-12(2,3)8-7-9-5-4-6-10(9)11/h9-11H,4-6H2,1-3H3/t9-,10+/m0/s1
InChIKeyJDIGGKMUXMYUNY-VHSXEESVSA-N
MW182.34 g/mol
LogP2.03
Rot. Bonds

About cis-(1R,2S)-2-(2-trimethylsilylethynyl)cyclopentan-1-ol

cis-(1R,2S)-2-(2-trimethylsilylethynyl)cyclopentan-1-ol (PubChem CID 11116689) has the molecular formula C10H18OSi and a molecular weight of 182.34 g/mol. Its IUPAC name is cis-(1R,2S)-2-(2-trimethylsilylethynyl)cyclopentan-1-ol.

Molecular Properties

Compound Namecis-(1R,2S)-2-(2-trimethylsilylethynyl)cyclopentan-1-ol
PubChem CID11116689
Molecular FormulaC10H18OSi
Molecular Weight182.34 g/mol
Exact Mass182.11
IUPAC Namecis-(1R,2S)-2-(2-trimethylsilylethynyl)cyclopentan-1-ol
SMILESC[Si](C)(C)C#C[C@@H]1CCC[C@H]1O
InChIInChI=1S/C10H18OSi/c1-12(2,3)8-7-9-5-4-6-10(9)11/h9-11H,4-6H2,1-3H3/t9-,10+/m0/s1
InChIKeyJDIGGKMUXMYUNY-VHSXEESVSA-N
XLogP2.03
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.34
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

(1S)-1-cyclopentyl-5-tri(propan-2-yl)silylpenta-2,4-diyn-1-ol
CID 164617863
trans-2-(t-Butyldimethylsilyloxymethyl)cyclopentanol
CID 11053444
trans-(1S,2R)-2-[[tert-butyl(dimethyl)silyl]methyl]cyclopentan-1-ol
CID 10900013
Tert-butyl-(2-ethynylcyclopentyl)oxy-dimethylsilane
CID 12630484
2-Oct-1-ynylcyclopentan-1-ol
CID 15049150
cis-(1S,3R)-3-(trimethylsilylmethyl)cyclopentan-1-ol
CID 102573022
(4S,5S)-2-methyl-5-trimethylsilyloct-6-yn-4-ol
CID 166439538
(4R,5R)-2-methyl-5-trimethylsilyloct-6-yn-4-ol
CID 166443605
cis-(1S,2R)-2-hex-1-ynylcyclopentan-1-ol
CID 15642869
trans-(1R,2R)-2-hex-1-ynylcyclopentan-1-ol
CID 15642870
cis-(1S,2R)-2-prop-1-ynylcyclopentan-1-ol
CID 12721681
1-Cyclopentyl-3-trimethylsilylprop-2-yn-1-ol
CID 12748621

Frequently Asked Questions

What is the IUPAC name of cis-(1R,2S)-2-(2-trimethylsilylethynyl)cyclopentan-1-ol?
The IUPAC name of cis-(1R,2S)-2-(2-trimethylsilylethynyl)cyclopentan-1-ol (CID 11116689) is cis-(1R,2S)-2-(2-trimethylsilylethynyl)cyclopentan-1-ol.
What is the SMILES notation for cis-(1R,2S)-2-(2-trimethylsilylethynyl)cyclopentan-1-ol?
The canonical SMILES for cis-(1R,2S)-2-(2-trimethylsilylethynyl)cyclopentan-1-ol is C[Si](C)(C)C#C[C@@H]1CCC[C@H]1O.
What is the InChIKey of cis-(1R,2S)-2-(2-trimethylsilylethynyl)cyclopentan-1-ol?
The InChIKey is JDIGGKMUXMYUNY-VHSXEESVSA-N. The full InChI is InChI=1S/C10H18OSi/c1-12(2,3)8-7-9-5-4-6-10(9)11/h9-11H,4-6H2,1-3H3/t9-,10+/m0/s1.
What are the key properties of cis-(1R,2S)-2-(2-trimethylsilylethynyl)cyclopentan-1-ol?
cis-(1R,2S)-2-(2-trimethylsilylethynyl)cyclopentan-1-ol has a molecular weight of 182.34 g/mol, XLogP of 2.03, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,2S)-2-(2-trimethylsilylethynyl)cyclopentan-1-ol is sourced from PubChem (CID 11116689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).